Monomers
Maleimide
Identifiers
IUPAC name
pyrrole-2,5-dione
InchI
InChI=1S/C4H3NO2/c6-3-1-2-4(7)5-3/h1-2H,(H,5,6,7)
InchI Key
PEEHTFAAVSWFBL-UHFFFAOYSA-N
SMILES
O=C1C=CC(=O)N1
Canonical SMILES
C1=CC(=O)NC1=O
Isomeric SMILES
C1=CC(=O)NC1=O
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H3NO2
Heavy Atom Count
7
Molecular Weight
97.073
Exact Molecular Weight
97.0164
Valence Electrons
36
Radical Electrons
0
tPSA
46.17
MolLogP
-0.801
H Bond Acceptors
2
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
0
MOL File
RDKit 3D
10 10 0 0 0 0 0 0 0 0999 V2000
2.4526 0.1668 -0.0176 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1925 0.1306 -0.0101 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4153 -1.1243 0.0332 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8829 -0.8161 0.0301 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0255 0.6347 -0.0147 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0955 1.2908 -0.0299 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2689 1.2042 -0.0391 N 0 0 0 0 0 0 0 0 0 0 0 0
0.8323 -2.1214 0.0623 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6777 -1.5738 0.0578 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5200 2.2084 -0.0719 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0
2 3 1 0
3 4 2 0
4 5 1 0
5 6 2 0
5 7 1 0
7 2 1 0
3 8 1 0
4 9 1 0
7 10 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers